N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine

C15H24N2O2 — CID 105065449

IUPACN-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine
SMILESCCNC(CC1CCOCC1)c1ccncc1OC
InChIInChI=1S/C15H24N2O2/c1-3-17-14(10-12-5-8-19-9-6-12)13-4-7-16-11-15(13)18-2/h4,7,11-12,14,17H,3,5-6,8-10H2,1-2H3
InChIKeyTYEYTOIBZBAIHX-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.56
Rot. Bonds6

About N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine

N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine (PubChem CID 105065449) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine
PubChem CID105065449
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine
SMILESCCNC(CC1CCOCC1)c1ccncc1OC
InChIInChI=1S/C15H24N2O2/c1-3-17-14(10-12-5-8-19-9-6-12)13-4-7-16-11-15(13)18-2/h4,7,11-12,14,17H,3,5-6,8-10H2,1-2H3
InChIKeyTYEYTOIBZBAIHX-UHFFFAOYSA-N
XLogP2.56
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-cyclobutyl-1-(3-methoxy-4-pyridinyl)ethyl]hydrazine
CID 105310161
N-[1-(2-methoxyphenyl)-2-(oxan-4-yl)ethyl]propan-1-amine
CID 62608474
3-[1-(ethylamino)-2-(oxolan-3-yl)ethyl]pyridin-4-amine
CID 103987393
2-cyclopropyl-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 64904236
N-ethyl-1-(3-methoxythiophen-2-yl)-2-(oxan-4-yl)ethanamine
CID 115847088
N-ethyl-2-(oxan-4-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126820
N-ethyl-2-(oxan-4-yl)-1-pyrimidin-5-ylethanamine
CID 102923393
1-(2-bromo-5-methoxyphenyl)-N-ethyl-2-(oxan-4-yl)ethanamine
CID 105138597
N-ethyl-1-(3-methoxy-4-pyridinyl)hex-5-en-1-amine
CID 105065659
1-(2,5-dimethoxyphenyl)-N-ethyl-2-(oxolan-3-yl)ethanamine
CID 103987375
2-cycloheptyl-N-ethyl-1-(2-methoxyphenyl)ethanamine
CID 115793056
2-(5-bromo-2-pyridinyl)-N-ethyl-1-(3-methoxy-4-pyridinyl)ethanamine
CID 105066036

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine?
The IUPAC name of N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine (CID 105065449) is N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine is CCNC(CC1CCOCC1)c1ccncc1OC.
What is the InChIKey of N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine?
The InChIKey is TYEYTOIBZBAIHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-3-17-14(10-12-5-8-19-9-6-12)13-4-7-16-11-15(13)18-2/h4,7,11-12,14,17H,3,5-6,8-10H2,1-2H3.
What are the key properties of N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine?
N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine has a molecular weight of 264.37 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-methoxy-4-pyridinyl)-2-(oxan-4-yl)ethanamine is sourced from PubChem (CID 105065449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).